Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 6/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.54 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8872400 | 0.84 | ADORA2B (0.69) | ADORA2BADORA2AKDM4EMEN1ALDH1A1 | |
| SCHEMBL6995974 | 0.82 | MEN1 (0.49) | ADORA2BADORA2AADORA3MEN1CYP1A2 | |
| SCHEMBL6997253 | 0.80 | ADORA2A (0.48) | ADORA2BADORA2AADORA3 | |
| SCHEMBL5230763 | 0.74 | ADORA2B (0.52) | ADORA2BADORA2AADORA3KDM4EMEN1 | |
| SCHEMBL10673069 | 0.71 | KDM4E (0.64) | ADORA2BADORA2AADORA3KDM4EALDH1A1 | |
| SCHEMBL2686441 | 0.71 | ADORA2B (0.52) | ADORA2BADORA2AADORA3KDM4EMEN1 | |
| SCHEMBL1720432 | 0.71 | ADORA2A (0.51) | ADORA2BADORA2AADORA3KDM4EMEN1 | |
| SCHEMBL5620839 | 0.67 | ADORA2B (0.54) | ADORA2BADORA2AKDM4EMEN1ALDH1A1 | |
| SCHEMBL25539381 | 0.66 | ADORA2A (0.58) | ADORA2BADORA2AADORA3 | |
| SCHEMBL661108 | 0.66 | ADORA2B (1.00) | ADORA2BADORA2AADORA3KDM4EMEN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0880524-A1 | NEW TRIAZOLOPURINES, METHOD OF PREPARING THEM AND THEIR USE AS DRUGS | Boehringer Ingelheim Pharma KG (DE) | 1998-12-02 | — | — | EP | disclosed |
| WO-1998003511-A1 | NEW TRIAZOLOPURINES, METHOD OF PREPARING THEM AND THEIR USE AS DRUGS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1998-01-29 | — | — | WO | disclosed |